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2,5'-Imino-1-(2-O-benzoyl-3-O-methylsulfonyl-B-D-arabinofuranosyl)-uracil
SpectraBase Compound ID AHAwfkQncCD
InChI InChI=1S/C17H17N3O7S/c1-28(23,24)27-13-11-9-18-17-19-12(21)7-8-20(17)15(25-11)14(13)26-16(22)10-5-3-2-4-6-10/h2-8,11,13-15H,9H2,1H3,(H,18,19,21)
InChIKey PVPQDIFHPMYGPO-UHFFFAOYSA-N
Mol Weight 407.4 g/mol
Molecular Formula C17H17N3O7S
Exact Mass 407.078721 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4fEnUJ6DtBU
Name 2,5'-Imino-1-(2-O-benzoyl-3-O-methylsulfonyl-B-D-arabinofuranosyl)-uracil
Comments JEOL FX90Q OR FX100Q SPECTROMETER, C10 SIGNAL AT 38.9-37.6, C11 AND C12-C17 SIGNALS AT 171.1- 166.2 AND 135.1-127.3 PPM, RESPECTIVELY
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Formula C17H17N3O7S
InChI InChI=1S/C17H17N3O7S/c1-28(23,24)27-13-11-9-18-17-19-12(21)7-8-20(17)15(25-11)14(13)26-16(22)10-5-3-2-4-6-10/h2-8,11,13-15H,9H2,1H3,(H,18,19,21)
InChIKey PVPQDIFHPMYGPO-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference D. Katalenic, V. Skaric, J. Chem. Soc. Perkin I 1065 (1992).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Acetone-D6